Nicotinamidine, N-p-tolyl-
TL;DR: Nicotinamidine, N-p-tolyl- (CAS 5472-88-8) is a chemical compound with molecular formula C13H13N3 and molecular weight 211.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(4-methylphenyl)pyridine-3-carboximidamide
Also Known As: N-p-Tolylnicotinamidine, Nicotinamidine, N-p-tolyl-, n'-(4-methylphenyl)pyridine-3-carboximidamide, 3-Pyridinecarboximidamide, N-(4-methylphenyl)-, 5-22-02-00118 (Beilstein Handbook Reference)
| Molecular Formula | C13H13N3 |
|---|---|
| Molecular Weight | 211.11 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.11095 |
| Heavy Atoms | 16 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 5472-88-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N=C(C2=CN=CC=C2)N |
| InChIKey | UXVZFZPIMQNYLG-UHFFFAOYSA-N |
Product Overview
Nicotinamidine, N-p-tolyl- (CAS 5472-88-8), with molecular formula C13H13N3 and molecular weight 211.11 g/mol. IUPAC: N'-(4-methylphenyl)pyridine-3-carboximidamide.
Chemical Property Profile of Nicotinamidine, N-p-tolyl-
Property Insights of Nicotinamidine, N-p-tolyl-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nicotinamidine, N-p-tolyl-. With a topological polar surface area (TPSA) of 51.3 Ų, Nicotinamidine, N-p-tolyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nicotinamidine, N-p-tolyl- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nicotinamidine, N-p-tolyl-?
The CAS number of Nicotinamidine, N-p-tolyl- is 5472-88-8.
What is the molecular formula of Nicotinamidine, N-p-tolyl-?
The molecular formula of Nicotinamidine, N-p-tolyl- is C13H13N3.
What is the molecular weight of Nicotinamidine, N-p-tolyl-?
The molecular weight of Nicotinamidine, N-p-tolyl- is 211.11 g/mol.
Where can I buy Nicotinamidine, N-p-tolyl-?
You can request a quote for Nicotinamidine, N-p-tolyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicotinamidine, N-p-tolyl-?
Yes, KEHONG BIO provides custom synthesis services for Nicotinamidine, N-p-tolyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.